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Search results for: '4808-70-2'
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2-Amino-5-ethylthio-1,3,4-thiadiazole
Cas Number: 25660-70-2Formula: C4H7N3S2Molecular weight: 161.24Synonyms: 25660-70-2|2-Amino-5-ethylthio-1,3,4-thiadiazole|1,3,4-Thiadiazol-2-amine, 5-(ethylthio)-|5-(Ethylth...SMILES: CCSC1=NN=C(S1)NInChIKey: VWRHSNKTSSIMGE-UHFFFAOYSA-NInChI: InChI=1S/C4H7N3S2/c1-2-8-4-7-6-3(5)9-4/h2H2,1H3,(H2,5,6)
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6-Bromo-2-chloro-3-ethylquinoline
Cas Number: 409346-70-9Formula: C11H9BrClNMolecular weight: 270.55Synonyms: 6-Bromo-2-chloro-3-ethylquinoline|409346-70-9|SCHEMBL667729|DTXSID40463099|MFCD09029946|AKOS00513789...SMILES: CCC1=C(N=C2C=CC(=CC2=C1)Br)ClInChIKey: RDBIGYMOEAEGJM-UHFFFAOYSA-NInChI: InChI=1S/C11H9BrClN/c1-2-7-5-8-6-9(12)3-4-10(8)14-11(7)13/h3-6H,2H2,1H3
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2-Iodo-5-methoxyphenol
Cas Number: 41046-70-2Formula: C7H7IO2Molecular weight: 250.03Synonyms: 2-IODO-5-METHOXYPHENOL|41046-70-2|MFCD12963849|2-iodo-5-methoxy-phenol|Phenol, 2-iodo-5-methoxy-|SCH...SMILES: COC1=CC(=C(C=C1)I)OInChIKey: UEKVFLARUBVPKA-UHFFFAOYSA-NInChI: InChI=1S/C7H7IO2/c1-10-5-2-3-6(8)7(9)4-5/h2-4,9H,1H3
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3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene
Cas Number: 214360-70-0Formula: C10H15BO2SMolecular weight: 210.1Synonyms: 214360-70-0|thiophene-3-boronic acid pinacol ester|4,4,5,5-tetramethyl-2-(thiophen-3-yl)-1,3,2-dioxa...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CSC=C2InChIKey: HQXQOBAEDQBINI-UHFFFAOYSA-NInChI: InChI=1S/C10H15BO2S/c1-9(2)10(3,4)13-11(12-9)8-5-6-14-7-8/h5-7H,1-4H3
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2-Chloro-3-(pyrrolidin-1-ylsulfonyl)pyridine
Cas Number: 60597-70-8Formula: C9H11ClN2O2SMolecular weight: 246.7Synonyms: 2-chloro-3-(pyrrolidin-1-ylsulfonyl)pyridine|60597-70-8|2-chloro-3-pyrrolidin-1-ylsulfonylpyridine|2...SMILES: C1CCN(C1)S(=O)(=O)C2=C(N=CC=C2)ClInChIKey: BQNRIDNMAGXHAV-UHFFFAOYSA-NInChI: InChI=1S/C9H11ClN2O2S/c10-9-8(4-3-5-11-9)15(13,14)12-6-1-2-7-12/h3-5H,1-2,6-7H2
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Ethyl 2-amino-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate
Cas Number: 350989-70-7Formula: C14H14FNO2SMolecular weight: 279.33Synonyms: ethyl 2-amino-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate|350989-70-7|MFCD01922031|2-Amino-4-...SMILES: CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)F)C)NInChIKey: JKQGEOJZNXXFDI-UHFFFAOYSA-NInChI: InChI=1S/C14H14FNO2S/c1-3-18-14(17)12-11(8(2)19-13(12)16)9-4-6-10(15)7-5-9/h4-7H,3,16H2,1-2H3
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O6-[4-(Trifluoroacetamidomethyl)benzyl]guanine
Cas Number: 680622-70-2Formula: C15H13F3N6O2Molecular weight: 366.3Synonyms: 680622-70-2|PIN1 inhibitor API-1|O6-[4-(Trifluoroacetamidomethyl)benzyl]guanine|N-(4-(((2-Amino-1H-p...SMILES: C1=CC(=CC=C1CNC(=O)C(F)(F)F)COC2=NC(=NC3=C2NC=N3)NInChIKey: AQFWAWXGBQPBIA-UHFFFAOYSA-NInChI: InChI=1S/C15H13F3N6O2/c16-15(17,18)13(25)20-5-8-1-3-9(4-2-8)6-26-12-10-11(22-7-21-10)23-14(19)24-12/h1-4,7H,5-6H2,(H,20,25)(H3,19,21,22,23,24)
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Caffeic acid phenethyl ester
Cas Number: 104594-70-9Formula: C17H16O4Molecular weight: 284.31Synonyms: Caffeic acid phenethyl ester|Phenethyl caffeate|104594-70-9|CAPE|Phenylethyl caffeate|115610-29-2|ph...SMILES: C1=CC=C(C=C1)CCOC(=O)C=CC2=CC(=C(C=C2)O)OInChIKey: SWUARLUWKZWEBQ-VQHVLOKHSA-NInChI: InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+
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Tetrabutylammonium perchlorate
Formula: C16H36ClNO4Molecular weight: 341.91Synonyms: Tetrabutylammonium perchlorate|1923-70-2|1-Butanaminium, N,N,N-tributyl-, perchlorate|Tetra-n-butyla...SMILES: CCCC[N+](CCCC)(CCCC)CCCC.[O-]Cl(=O)(=O)=OInChIKey: KBLZDCFTQSIIOH-UHFFFAOYSA-MInChI: InChI=1S/C16H36N.ClHO4/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1(3,4)5/h5-16H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
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(R)-1-Boc-2-ethyl-piperazine
Cas Number: 393781-70-9Formula: C11H22N2O2Molecular weight: 214.3Synonyms: (R)-1-Boc-2-ethylPiperazine|393781-70-9|(R)-1-Boc-2-Ethyl-piperazine|(R)-tert-butyl 2-ethylpiperazin...SMILES: CCC1CNCCN1C(=O)OC(C)(C)CInChIKey: CTCGRXDGXGUOTE-SECBINFHSA-NInChI: InChI=1S/C11H22N2O2/c1-5-9-8-12-6-7-13(9)10(14)15-11(2,3)4/h9,12H,5-8H2,1-4H3/t9-/m1/s1
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Methyl 5-(bromomethyl)pyrazine-2-carboxylate
Cas Number: 193966-70-0Formula: C7H7BrN2O2Molecular weight: 231.05Synonyms: METHYL 5-(BROMOMETHYL)PYRAZINE-2-CARBOXYLATE|193966-70-0|Methyl-5-(bromomethyl)pyrazine-2-carboxylat...SMILES: COC(=O)C1=NC=C(N=C1)CBrInChIKey: OIGRHUBIDWZLHR-UHFFFAOYSA-NInChI: InChI=1S/C7H7BrN2O2/c1-12-7(11)6-4-9-5(2-8)3-10-6/h3-4H,2H2,1H3
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2-Chloro-5-methoxy-3-methylpyridine
Cas Number: 74650-70-7Formula: C7H8ClNOMolecular weight: 157.6Synonyms: 2-Chloro-5-methoxy-3-methylpyridine|74650-70-7|SCHEMBL5942363|DTXSID90511473|GHLYOKOAECDWQL-UHFFFAOY...SMILES: CC1=CC(=CN=C1Cl)OCInChIKey: GHLYOKOAECDWQL-UHFFFAOYSA-NInChI: InChI=1S/C7H8ClNO/c1-5-3-6(10-2)4-9-7(5)8/h3-4H,1-2H3
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1H-Indole-2-methanol
Cas Number: 24621-70-3Formula: C9H9NOMolecular weight: 147.17Synonyms: (1H-Indol-2-yl)methanol|24621-70-3|1H-Indole-2-methanol|1H-indol-2-ylmethanol|(1H-Indol-2-yl)-methan...SMILES: C1=CC=C2C(=C1)C=C(N2)COInChIKey: XEEANGGQJOWRTG-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO/c11-6-8-5-7-3-1-2-4-9(7)10-8/h1-5,10-11H,6H2
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2-Amino-5-methoxyphenol
Cas Number: 40925-70-0Formula: C7H9NO2Molecular weight: 139.15Synonyms: 2-Amino-5-methoxyphenol|40925-70-0|3-hydroxy-4-aminoanisole|2-HYDROXY-4-METHOXYANILINE|5-methoxy-2-a...SMILES: COC1=CC(=C(C=C1)N)OInChIKey: AOWNYDDZDLTCGB-UHFFFAOYSA-NInChI: InChI=1S/C7H9NO2/c1-10-5-2-3-6(8)7(9)4-5/h2-4,9H,8H2,1H3
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N-(2-Hydroxy-5-iodopyridin-3-yl)acetamide
Cas Number: 1186310-70-2Formula: C7H7IN2O2Molecular weight: 278.05Synonyms: AKOS015856410 | N-(2-hydroxy-5-iodo-3-pyridyl)acetamide | N-(5-Iodo-2-oxo-1,2-dihydropyridin-3-yl)ac...SMILES: CC(=O)NC1=CC(=CNC1=O)IInChIKey: FBJQVCGPAZOJAE-UHFFFAOYSA-NInChI: InChI=1S/C7H7IN2O2/c1-4(11)10-6-2-5(8)3-9-7(6)12/h2-3H,1H3,(H,9,12)(H,10,11)
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trans-3-(2-hydroxypropan-2-yl)cyclobutane-1-carboxylic acid
Cas Number: 1940136-70-8Formula: C8H14O3Molecular weight: 158.2Synonyms: trans-3-(2-hydroxypropan-2-yl)cyclobutane-1-carboxylic acid | 1940136-13-9 | 1940136-70-8 | cis-3-(2...SMILES: CC(C)(C1CC(C1)C(=O)O)OInChIKey: ICEGZBJHMBTOFV-UHFFFAOYSA-NInChI: InChI=1S/C8H14O3/c1-8(2,11)6-3-5(4-6)7(9)10/h5-6,11H,3-4H2,1-2H3,(H,9,10)
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2-Amino-4-methoxynicotinonitrile
Cas Number: 98651-70-8Formula: C7H7N3OMolecular weight: 149.2Synonyms: 2-Amino-4-Methoxynicotinonitrile|98651-70-8|2-amino-4-methoxypyridine-3-carbonitrile|2-Amino-4-metho...SMILES: COC1=C(C(=NC=C1)N)C#NInChIKey: ULYBLKYAFIOZRK-UHFFFAOYSA-NInChI: InChI=1S/C7H7N3O/c1-11-6-2-3-10-7(9)5(6)4-8/h2-3H,1H3,(H2,9,10)
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Ethyl 2-(2-(4-chlorophenyl)thiazol-4-yl)acetate
Cas Number: 20287-70-1Formula: C13H12ClNO2SMolecular weight: 281.8Synonyms: Ethyl 2-(2-(4-chlorophenyl)thiazol-4-yl)acetate|20287-70-1|ethyl 2-[2-(4-chlorophenyl)-1,3-thiazol-4...SMILES: CCOC(=O)CC1=CSC(=N1)C2=CC=C(C=C2)ClInChIKey: VTDNBASRFGRNAV-UHFFFAOYSA-NInChI: InChI=1S/C13H12ClNO2S/c1-2-17-12(16)7-11-8-18-13(15-11)9-3-5-10(14)6-4-9/h3-6,8H,2,7H2,1H3
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Dasatinib-d8
Cas Number: 1132093-70-9Formula: C22H18D8ClN7O2SMolecular weight: 496.05Synonyms: SCHEMBL13804153 | DTXSID30649385 | N-(2-chloro-6-methylphenyl)-2-[[2-methyl-6-[2,2,3,3,5,5,6,6-octad...SMILES: CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=CC(=NC(=N3)C)N4CCN(CC4)CCOInChIKey: ZBNZXTGUTAYRHI-COMRDEPKSA-NInChI: InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)/i6D2,7D2,8D2,9D2
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tert-butyl (2S,3S)-2-(hydroxymethyl)-3-methyl-pyrrolidine-1-carboxylate
Cas Number: 817554-70-4Formula: C11H21NO3Molecular weight: 215.29Synonyms: 817554-70-4 | (2S,3S)-tert-Butyl 2-(hydroxymethyl)-3-methylpyrrolidine-1-carboxylate | SCHEMBL114868...SMILES: CC1CCN(C1CO)C(=O)OC(C)(C)CInChIKey: FPUBEXOAVGKKCY-DTWKUNHWSA-NInChI: InChI=1S/C11H21NO3/c1-8-5-6-12(9(8)7-13)10(14)15-11(2,3)4/h8-9,13H,5-7H2,1-4H3/t8-,9+/m0/s1
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methyl (2S)-4-(tert-butoxycarbonylamino)-2-(difluoromethoxy)butanoate
Cas Number: 1807916-70-6Formula: C11H19NO5F2Molecular weight: 283.27Synonyms: 1807916-70-6 | Methyl (2S)-4-{[(tert-butoxy)carbonyl]amino}-2-(difluoromethoxy)butanoate | (S)-Methy...SMILES: CC(C)(C)OC(=O)NCCC(C(=O)OC)OC(F)FInChIKey: JJRIXCNNEPCVPN-ZETCQYMHSA-NInChI: InChI=1S/C11H19F2NO5/c1-11(2,3)19-10(16)14-6-5-7(8(15)17-4)18-9(12)13/h7,9H,5-6H2,1-4H3,(H,14,16)/t7-/m0/s1
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N-methyl-3-(trifluoromethyl)aniline
Cas Number: 2026-70-2Formula: C8H8F3NMolecular weight: 175.2Synonyms: N-methyl-3-(trifluoromethyl)aniline|2026-70-2|methyl-(3-trifluoromethyl-phenyl)-amine|Benzenamine, N...SMILES: CNC1=CC=CC(=C1)C(F)(F)FInChIKey: SRTKIHVQZYXHHJ-UHFFFAOYSA-NInChI: InChI=1S/C8H8F3N/c1-12-7-4-2-3-6(5-7)8(9,10)11/h2-5,12H,1H3
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2-Iodo-6-methoxy-pyridine
Cas Number: 182275-70-3Formula: C6H6INOMolecular weight: 235.02Synonyms: 2-Iodo-6-methoxypyridine|182275-70-3|2-Iodo-6-methoxy-pyridine|PYRIDINE, 2-IODO-6-METHOXY-|MFCD07366...SMILES: COC1=NC(=CC=C1)IInChIKey: ZMTZHYATPMNUJR-UHFFFAOYSA-NInChI: InChI=1S/C6H6INO/c1-9-6-4-2-3-5(7)8-6/h2-4H,1H3
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4',5,7-TRIMETHOXYFLAVONE
Cas Number: 5631-70-9Formula: C18H16O5Molecular weight: 312.32Synonyms: 4',5,7-Trimethoxyflavone|5631-70-9|Trimethylapigenin|Apigenin trimethyl ether|5,7,4'-Trimethoxyflavo...SMILES: COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3OC)OCInChIKey: ZXJJBDHPUHUUHD-UHFFFAOYSA-NInChI: InChI=1S/C18H16O5/c1-20-12-6-4-11(5-7-12)15-10-14(19)18-16(22-3)8-13(21-2)9-17(18)23-15/h4-10H,1-3H3
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